[[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
TL;DR: [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate (CAS 287928-01-2) is a chemical compound with molecular formula C23H23Cl2N3O3 and molecular weight 459.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
Also Known As: [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate|[2-[4-(1,1-Dimethylethyl)phenyl]-1-iminoethyl]azanyl 3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxylate
| Molecular Formula | C23H23Cl2N3O3 |
|---|---|
| Molecular Weight | 459.11 g/mol |
| LogP | 5.92602 |
| Topological Polar Surface Area | 90.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.11163 |
| Heavy Atoms | 31 |
| Complexity | 1109.7087 |
Chemical Identifiers
| CAS Number | 287928-01-2 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)ON=C(CC3=CC=C(C=C3)C(C)(C)C)N |
Product Overview
[[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate (CAS 287928-01-2), with molecular formula C23H23Cl2N3O3 and molecular weight 459.11 g/mol. IUPAC: [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate.
Chemical Property Profile of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
Property Insights of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
The XLogP value of 5.92602 indicates that [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.71 Ų falls within the moderate polarity range, balancing permeability and solubility for [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate. Following Lipinski's Rule of Five, [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate?
The CAS number of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 287928-01-2.
What is the molecular formula of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate?
The molecular formula of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is C23H23Cl2N3O3.
What is the molecular weight of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate?
The molecular weight of [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate is 459.11 g/mol.
Where can I buy [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate?
You can request a quote for [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [[1-amino-2-(4-tert-butylphenyl)ethylidene]amino] 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.